N-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine

C9H14N2 — CID 142054800

IUPACN-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine
SMILESC=C1NCCC/C1=C/N=C/C
InChIInChI=1S/C9H14N2/c1-3-10-7-9-5-4-6-11-8(9)2/h3,7,11H,2,4-6H2,1H3/b9-7-,10-3+
InChIKeyUCUIVECLAWGHDF-NWPUNZMFSA-N
MW150.22 g/mol
LogP1.86
Rot. Bonds1

About N-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine

N-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine (PubChem CID 142054800) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is N-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine.

Molecular Properties

Compound NameN-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine
PubChem CID142054800
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC NameN-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine
SMILESC=C1NCCC/C1=C/N=C/C
InChIInChI=1S/C9H14N2/c1-3-10-7-9-5-4-6-11-8(9)2/h3,7,11H,2,4-6H2,1H3/b9-7-,10-3+
InChIKeyUCUIVECLAWGHDF-NWPUNZMFSA-N
XLogP1.86
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

6-(3-Methylbut-3-enyl)-1,2-dihydropyrazine
CID 117656494
(E)-2-ethenyl-4-methylimino-N-[(E)-piperidin-2-ylidenemethyl]but-2-en-1-amine
CID 141944458
ethane;N-[(Z)-(2-methylpiperidin-3-ylidene)methyl]ethanimine
CID 142070283
N-[(Z)-[(2Z)-2-butan-2-ylidenepiperidin-3-ylidene]methyl]ethanimine
CID 142253748
6-Methyl-1,2,3,4-tetrahydropyrido[2,3-c]azepin-6-amine
CID 142291616
8-Methyl-1,2,3,4-tetrahydropyrido[3,2-c]azepin-8-amine
CID 142291619
(2Z)-2-[(2Z)-2-butan-2-ylidenepiperidin-3-ylidene]-N-methylethanimine
CID 143012851
6-methyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-c]azepine
CID 144887040
N-[(Z)-(2-propan-2-ylidenepiperidin-3-ylidene)methyl]ethanimine
CID 145448920
(2Z)-N-methyl-2-(2-methylidenepiperidin-3-ylidene)ethanimine
CID 153624861
N-(3,4-dihydropyridin-5-ylmethyl)-2-methylpropan-2-amine
CID 154993224
4-methyl-N-(2-prop-1-en-2-yliminoethyl)pent-4-en-1-amine
CID 166944977

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine?
The IUPAC name of N-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine (CID 142054800) is N-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine.
What is the SMILES notation for N-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine?
The canonical SMILES for N-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine is C=C1NCCC/C1=C/N=C/C.
What is the InChIKey of N-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine?
The InChIKey is UCUIVECLAWGHDF-NWPUNZMFSA-N. The full InChI is InChI=1S/C9H14N2/c1-3-10-7-9-5-4-6-11-8(9)2/h3,7,11H,2,4-6H2,1H3/b9-7-,10-3+.
What are the key properties of N-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine?
N-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine has a molecular weight of 150.22 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine is sourced from PubChem (CID 142054800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).